ATOM 23
1 C7a C 22.2808 -17.4707
2 O7a O 23.6911 -16.6657
3 C1a C 21.0805 -16.7777
4 O6a O 22.2808 -18.8566
5 C1z C 25.7730 -15.3317
6 C1y C 26.6502 -16.4080
7 C1z C 26.0676 -13.9775
8 C1y C 24.3899 -15.4664
9 C1a C 24.7357 -16.6237
10 C1y C 28.0464 -16.3919
11 O7x O 26.2299 -17.7430
12 C1y C 27.3166 -13.3565
13 C1x C 24.8680 -13.2725
14 O1a O 26.0029 -12.5546
15 C1x C 23.8310 -14.1956
16 C2y C 28.4902 -17.7126
17 C1x C 28.8944 -15.2915
18 C7x C 27.3715 -18.5487
19 C1x C 28.5785 -13.9432
20 C1b C 27.3840 -11.9591
21 C2a C 29.8154 -18.1267
22 O6a O 27.3858 -19.9368
23 O1a O 28.6105 -11.3302
BOND 25
1 1 3 1
2 1 2 1
3 1 4 2
4 5 6 1
5 5 7 1
6 5 8 1
7 5 9 1 #Up
8 6 10 1
9 6 11 1
10 7 12 1
11 7 13 1
12 7 14 1 #Down
13 8 15 1
14 8 2 1 #Up
15 10 16 1
16 10 17 1
17 11 18 1
18 12 19 1
19 12 20 1 #Up
20 16 21 2
21 18 22 2
22 20 23 1
23 13 15 1
24 16 18 1
25 17 19 1
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